Geometry & MOs

Info

ID:	29386
PubChem CID:	833467
Reduced:	BrNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	317.04153
ΔH_f, kcal/mol:	-33.51
Dipole, Da:	5.78
IP(EA), eV:	-8.75(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-ethyl-4-methyl-N-phenylbenzamide

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)C)Br

DOS

IR

Vibrations